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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 6-Oct-2023 | /fDavies_Ph_correct_isomer fDavies_Ph_CT_iso_TS1 | Guo, Wentao | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization TS | RB3LYP | GENECP | -14577.8726319; Eh | |||
 | 6-Oct-2023 | /fDavies_Ph_correct_isomer fDavies_Ph_TT_iso_TS1 | Guo, Wentao | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization TS | RB3LYP | GENECP | -14577.8650826; Eh | |||
 | 6-Oct-2023 | /fDavies_Ph_correct_isomer fDavies_Ph_iso_SM | Guo, Wentao | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | RB3LYP | GENECP | -14577.8885269; Eh | |||
 | 6-Oct-2023 | /fDavies_Ph_correct_isomer fDavies_Ph_TA_iso_TS1 | Guo, Wentao | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization TS | RB3LYP | GENECP | -14577.8509735; Eh | |||
 | 6-Oct-2023 | /fDavies_Ph_correct_isomer fDavies_Ph_CA_iso_TS1 | Guo, Wentao | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization TS | RB3LYP | GENECP | -14577.8599318; Eh |
Results 61-65 of 65 (Search time: 0.001 seconds).